2-[(1-azanyl-4-phenyl-imidazol-2-yl)sulfanylmethyl]-6,7-dimethoxy-1H-quinazolin-4-one

Systemtic Name: 2-[(1-azanyl-4-phenyl-imidazol-2-yl)sulfanylmethyl]-6,7-dimethoxy-1H-quinazolin-4-one Openeye Name: 2-[(1-amino-4-phenyl-imidazol-2-yl)sulfanylmethyl]-6,7-dimethoxy-1H-quinazolin-4-one CAS Name: 2-[[(1-amino-4-phenyl-2-imidazolyl)thio]methyl]-6,7-dimethoxy-1H-quinazolin-4-one IUPAC Name: 2-[(1-amino-4-phenylimidazol-2-yl)sulfanylmethyl]-6,7-dimethoxy-1H-quinazolin-4-one Traditional Name: 2-[[(1-amino-4-phenyl-imidazol-2-yl)thio]methyl]-6,7-dimethoxy-1H-quinazolin-4-one Formula: C20H19N5O3S MolecularWeight: 409.46156

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N=C(N2)CSC3=NC(=CN3N)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N=C(N2)CSC3=NC(=CN3N)C4=CC=CC=C4)OC

InChI

InChI=1S/C20H19N5O3S/c1-27-16-8-13-14(9-17(16)28-2)22-18(24-19(13)26)11-29-20-23-15(10-25(20)21)12-6-4-3-5-7-12/h3-10H,11,21H2,1-2H3,(H,22,24,26)